3-morpholin-4-yl-3-phenylhexanoic acid

C16H23NO3 — CID 64528715

IUPAC3-morpholin-4-yl-3-phenylhexanoic acid
SMILESCCCC(CC(=O)O)(c1ccccc1)N1CCOCC1
InChIInChI=1S/C16H23NO3/c1-2-8-16(13-15(18)19,14-6-4-3-5-7-14)17-9-11-20-12-10-17/h3-7H,2,8-13H2,1H3,(H,18,19)
InChIKeyUKXROXKDVXGXMM-UHFFFAOYSA-N
MW277.36 g/mol
LogP2.49
Rot. Bonds6

About 3-morpholin-4-yl-3-phenylhexanoic acid

3-morpholin-4-yl-3-phenylhexanoic acid (PubChem CID 64528715) has the molecular formula C16H23NO3 and a molecular weight of 277.36 g/mol. Its IUPAC name is 3-morpholin-4-yl-3-phenylhexanoic acid.

Molecular Properties

Compound Name3-morpholin-4-yl-3-phenylhexanoic acid
PubChem CID64528715
Molecular FormulaC16H23NO3
Molecular Weight277.36 g/mol
Exact Mass277.17
IUPAC Name3-morpholin-4-yl-3-phenylhexanoic acid
SMILESCCCC(CC(=O)O)(c1ccccc1)N1CCOCC1
InChIInChI=1S/C16H23NO3/c1-2-8-16(13-15(18)19,14-6-4-3-5-7-14)17-9-11-20-12-10-17/h3-7H,2,8-13H2,1H3,(H,18,19)
InChIKeyUKXROXKDVXGXMM-UHFFFAOYSA-N
XLogP2.49
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-morpholin-4-yl-3-phenylhexanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-morpholin-4-yl-2-phenylpentanamide
CID 129053011
3-hydroxy-N-(2-methyl-2-morpholin-4-ylpropyl)-3-phenylbutanamide
CID 110024325
3-(2-methylphenyl)-3-morpholin-4-ylbutanoic acid
CID 64527538
3-(4-chlorophenyl)-3-morpholin-4-ylbutanoic acid
CID 64528314
2-ethyl-4-morpholin-4-yl-2-phenylbutanamide
CID 18114
3-methyl-3-morpholin-4-ylpentanoic acid
CID 64527149
3-(4-fluorophenyl)-3-pyrrolidin-1-ylpentanoic acid
CID 64529113
(1-hydroxy-1-morpholin-4-ylpropyl) 2-phenylacetate
CID 3029446
3-(3-fluorophenyl)-3-pyrrolidin-1-ylpentanoic acid
CID 114873020
4-morpholin-4-yl-3,3-diphenylbutan-2-one
CID 23423770
4-(4-benzyltetradecan-4-yl)morpholine
CID 54485656
2-(1,4-oxazepan-4-yl)-2-propylpentanoic acid
CID 114994067

Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-yl-3-phenylhexanoic acid?
The IUPAC name of 3-morpholin-4-yl-3-phenylhexanoic acid (CID 64528715) is 3-morpholin-4-yl-3-phenylhexanoic acid.
What is the SMILES notation for 3-morpholin-4-yl-3-phenylhexanoic acid?
The canonical SMILES for 3-morpholin-4-yl-3-phenylhexanoic acid is CCCC(CC(=O)O)(c1ccccc1)N1CCOCC1.
What is the InChIKey of 3-morpholin-4-yl-3-phenylhexanoic acid?
The InChIKey is UKXROXKDVXGXMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO3/c1-2-8-16(13-15(18)19,14-6-4-3-5-7-14)17-9-11-20-12-10-17/h3-7H,2,8-13H2,1H3,(H,18,19).
What are the key properties of 3-morpholin-4-yl-3-phenylhexanoic acid?
3-morpholin-4-yl-3-phenylhexanoic acid has a molecular weight of 277.36 g/mol, XLogP of 2.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-yl-3-phenylhexanoic acid is sourced from PubChem (CID 64528715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).